SCHEMBL4804580

SCHEMBL4804580

CS(=O)(=O)Nc1cc(OC[C@@H](O)CN(Cc2ccccc2)[C@H]2CC[C@H](c3ccc(O)cc3)CC2)ccc1OCc1ccccc1

nearest known ligand 0.40

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
KCNH2 Q12809 3/20 0.40
PRMT5 O14744 1/20 0.38
WDR77 Q9BQA1 1/20 0.38
ADRB3 P13945 4/20 0.38
ABCB1 P08183 1/20 0.38
ADRB2 P07550 1/20 0.37
ADRB1 P08588 1/20 0.37
NR3C1 P04150 1/20 0.37
CSF1R P07333 2/20 0.36
CYP19A1 P11511 1/20 0.35

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL4804593 1.00 KCNH2 (0.40) KCNH2PRMT5WDR77ADRB3ABCB1
SCHEMBL4804569 1.00 KCNH2 (0.40) KCNH2PRMT5WDR77ADRB3ABCB1
SCHEMBL3290827 0.96 KCNH2 (0.42) KCNH2PRMT5WDR77ADRB3ABCB1
SCHEMBL3290825 0.96 KCNH2 (0.42) KCNH2PRMT5WDR77ADRB3ABCB1
SCHEMBL4802793 0.95 KCNH2 (0.40) KCNH2PRMT5WDR77ADRB3ABCB1
SCHEMBL4802813 0.95 KCNH2 (0.40) KCNH2PRMT5WDR77ADRB3ABCB1
SCHEMBL4802806 0.95 KCNH2 (0.40) KCNH2PRMT5WDR77ADRB3ABCB1
SCHEMBL3576133 0.93 MRGPRX4 (0.40) KCNH2PRMT5WDR77ADRB3ABCB1
SCHEMBL3576131 0.93 MRGPRX4 (0.40) KCNH2PRMT5WDR77ADRB3ABCB1
SCHEMBL3287770 0.93 KCNH2 (0.40) KCNH2PRMT5WDR77ADRB3ABCB1

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7453010-B2 Phenylcyclohexylpropanolamine derivatives, preparation and therapeutic application thereof SANOFI AVENTIS (FR) 2008-11-18 US disclosed
US-20060100283-A1 Phenylcyclohexylpropanolamine derivatives, preparation and therapeutic application thereof SANOFI-AVENTIS (FR) 2006-05-11 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20060100283-A1 Phenylcyclohexylpropanolamine derivatives, preparation and therapeutic application thereof CHRM1, CHRM2, C1R KCNH2 905/4885PRMT5 700/4885WDR77 1387/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.